add hint on the default displacement

autoatml · Dec 26, 2024 · 74da25a · 74da25a
1 parent e562ce3
commit 74da25a
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/src/autoplex/auto/phonons/flows.py b/src/autoplex/auto/phonons/flows.py
@@ -86,9 +86,9 @@ class CompleteDFTvsMLBenchmarkWorkflow(Maker):
         Must be provided if distorting volume without specifying a range, or if distorting angles.
         Default=10.
     displacements: list[float]
-        Displacement distances for phonon data generation.
+        Displacement distances for phonon data generation for the fiting.
         Only 0.01 is used for the benchmark at the moment.
-        Might be changed later.
+        This value can currently not be changed.
     symprec: float
         Symmetry precision to use in the
         reduction of symmetry to find the primitive/conventional cell